N-(6-azanyl-2-butylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-4-methyl-benzamide

Systemtic Name: N-(6-azanyl-2-butylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-4-methyl-benzamide Openeye Name: N-(6-amino-2-butylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-methyl-benzamide CAS Name: N-[6-amino-2-(butylthio)-4-oxo-1H-pyrimidin-5-yl]-4-methylbenzamide IUPAC Name: N-(6-amino-2-butylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-methylbenzamide Traditional Name: N-[6-amino-2-(butylthio)-4-keto-1H-pyrimidin-5-yl]-4-methyl-benzamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H20N4O2S/c1-3-4-9-23-16-19-13(17)12(15(22)20-16)18-14(21)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H,18,21)(H3,17,19,20,22)